SCHEMBL6861174

SCHEMBL6861174

CC[Si](CC)(CC)OC1C(=O)N(C(=O)OC(C)C)C1c1cccs1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
HTT P42858 2/20 0.41
GAA P10253 1/20 0.41
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ADORA2B P29275 8/20 0.39
RXFP1 Q9HBX9 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
PKM P14618 1/20 0.37
KDM4E B2RXH2 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6861172 1.00 POLB (0.42) POLBHTTGAAALDH1A1SMN1; SMN2
SCHEMBL6861179 1.00 POLB (0.42) POLBHTTGAAALDH1A1SMN1; SMN2
SCHEMBL6858758 0.89 PKM (0.46) POLBHTTALDH1A1ADORA2BMEN1
SCHEMBL6858753 0.89 PKM (0.46) POLBHTTALDH1A1ADORA2BMEN1
SCHEMBL6858762 0.89 PKM (0.46) POLBHTTALDH1A1ADORA2BMEN1
SCHEMBL6861579 0.88 ADORA2B (0.46) POLBHTTALDH1A1SMN1; SMN2ADORA2B
SCHEMBL6861582 0.88 ADORA2B (0.46) POLBHTTALDH1A1SMN1; SMN2ADORA2B
SCHEMBL6861585 0.88 ADORA2B (0.46) POLBHTTALDH1A1SMN1; SMN2ADORA2B
SCHEMBL6853148 0.86 KMT2A (0.37) POLBHTTALDH1A1SMN1; SMN2ADORA2B
SCHEMBL6839944 0.86 HTT (0.40) POLBHTTGAAALDH1A1ADORA2B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6794523-B2 ANTICANCER AGENTS, ANTITUMOR AGENTS; LEUKEMIA FLORIDA STATE UNIVERSITY 2004-09-21 US disclosed
US-20030065200-A1 Anticancer agents, antitumor agents; leukemia FLORIDA STATE UNIVERSITY 2003-04-03 US disclosed
US-6018073-A Tricyclic taxanes having an alkoxy, alkenoxy or aryloxy substituted side-chain and pharmaceutical compositions containing them FLORIDA STATE UNIVERSITY (US) 2000-01-25 US disclosed
US-5739362-A ANTILEUKEMIA, ANTITUMOR AGENTS FLORIDA STATE UNIVERSITY (US) 1998-04-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030065200-A1 Anticancer agents, antitumor agents; leukemia MCL1, BCL3, TOP2A POLB 928/4885HTT 2133/4885GAA 716/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.